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CHEBI:179859 - 8-C-Glucopyranosyleriodictylol

ChEBI IDCHEBI:179859
ChEBI Name8-C-Glucopyranosyleriodictylol
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SubmitterMetaboLights
DownloadsMolfile
FormulaC21H22O11
Net Charge0
Average Mass450.396
Monoisotopic Mass450.11621
SMILES[H][C@@]1(c2c(O)cc(O)c3c2OC(c2ccc(O)c(O)c2)CC3=O)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C21H22O11/c22-6-14-17(28)18(29)19(30)21(32-14)16-11(26)4-10(25)15-12(27)5-13(31-20(15)16)7-1-2-8(23)9(24)3-7/h1-4,13-14,17-19,21-26,28-30H,5-6H2/t13?,14-,17-,18+,19-,21+/m1/s1
InChIKeyCMVYWFJFAHQVQP-GJNDOSSTSA-N
ChEBI Ontology
Outgoing Relation(s)
8-C-Glucopyranosyleriodictylol (CHEBI:179859) is a C-glycosyl compound (CHEBI:20857)
8-C-Glucopyranosyleriodictylol (CHEBI:179859) is a flavonoids (CHEBI:72544)
IUPAC Name 
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2,3-dihydrochromen-4-one
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